[2-(4-bromophenyl)-2-[(4-methylphenyl)sulfonylamino]ethyl] thiocyanate

Systemtic Name: [2-(4-bromophenyl)-2-[(4-methylphenyl)sulfonylamino]ethyl] thiocyanate Openeye Name: [2-(4-bromophenyl)-2-(p-tolylsulfonylamino)ethyl] thiocyanate CAS Name: thiocyanic acid [2-(4-bromophenyl)-2-[(4-methylphenyl)sulfonylamino]ethyl] ester IUPAC Name: [2-(4-bromophenyl)-2-[(4-methylphenyl)sulfonylamino]ethyl] thiocyanate Traditional Name: thiocyanic acid [2-(4-bromophenyl)-2-(tosylamino)ethyl] ester Formula: C16H15BrN2O2S2 MolecularWeight: 411.3365

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(CSC#N)C2=CC=C(C=C2)Br

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(CSC#N)C2=CC=C(C=C2)Br

InChI

InChI=1S/C16H15BrN2O2S2/c1-12-2-8-15(9-3-12)23(20,21)19-16(10-22-11-18)13-4-6-14(17)7-5-13/h2-9,16,19H,10H2,1H3